5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide

C16H20N4O3S2 — CID 8762613

IUPAC5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2nccs2)c1
InChIInChI=1S/C16H20N4O3S2/c1-19(2)25(22,23)12-5-6-14(20-8-3-4-9-20)13(11-12)15(21)18-16-17-7-10-24-16/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,17,18,21)
InChIKeyTUFPXVPLOXZIMZ-UHFFFAOYSA-N
MW380.50 g/mol
LogP2.25
Rot. Bonds5

About 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide

5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 8762613) has the molecular formula C16H20N4O3S2 and a molecular weight of 380.50 g/mol. Its IUPAC name is 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID8762613
Molecular FormulaC16H20N4O3S2
Molecular Weight380.50 g/mol
Exact Mass380.10
IUPAC Name5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2nccs2)c1
InChIInChI=1S/C16H20N4O3S2/c1-19(2)25(22,23)12-5-6-14(20-8-3-4-9-20)13(11-12)15(21)18-16-17-7-10-24-16/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,17,18,21)
InChIKeyTUFPXVPLOXZIMZ-UHFFFAOYSA-N
XLogP2.25
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.50
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide (CID 8762613) is 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide is CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)Nc2nccs2)c1.
What is the InChIKey of 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is TUFPXVPLOXZIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3S2/c1-19(2)25(22,23)12-5-6-14(20-8-3-4-9-20)13(11-12)15(21)18-16-17-7-10-24-16/h5-7,10-11H,3-4,8-9H2,1-2H3,(H,17,18,21).
What are the key properties of 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide?
5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 380.50 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 8762613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).